All Stories

  1. A novel electrochemical sensor for the detection of zearalenone in food matrices using PEGylated Fe3O4 nanoparticles supported by in-silico and multidetector AF4
  2. Integration of multiwalled carbon nanotubes with cobalt oxide for smart electrochemical sensing of epicatechin in foods
  3. Smart electrochemical immunosensing of aflatoxin B1 based on a palladium nanoparticle-boron nitride-coated carbon felt electrode for the wine industry
  4. Smart electrochemical sensing of xylitol using a combined machine learning and simulation approach
  5. An emerging machine learning strategy for electrochemical sensor and supercapacitor using carbonized metal–organic framework
  6. Smart electrochemical immunosensor for detection of aspartame in dietary products supported by in silico methods
  7. Insights into the Design of An Enzyme Free Sustainable Sensing Platform for Efavirenz
  8. A combined experimental-computational approach for electrocatalytic detection of epinephrine using nanocomposite sensor based on polyaniline/nickel oxide
  9. Smart Electrochemical Sensing of Xylitol Using a Combined Machine Learning and Simulation Approach
  10. Electrocatalysis of Endosulfan Based on Fe3O4: An Experimental and Computational Approach
  11. Functionalized Electrochemical Aptasensor for Sensing of Ochratoxin A in Cereals Supported by in Silico Adsorption Studies
  12. Removal of Targeted Pharmaceuticals and Personal Care Products from Wastewater Treatment Plants using QSAR Model
  13. Separation of Sucralose in Food Samples using Amines as Background Electrolyte Supported with DFT Calculations
  14. Evaluation of the catalytic activity of graphene oxide and zinc oxide nanoparticles on the electrochemical sensing of T1R2-Rebaudioside A complex supported by in silico methods
  15. Sensitivity Enhancement of Pre-Capillary Chelation Method for the Separation of Metal Ions: Experimental and DFT Study
  16. Measurement of TiO2 Nanoscale Ingredients in Sunscreens by Multidetector AF4, TEM, and spICP-MS Supported by Computational Modeling
  17. An in-silico layer-by-layer adsorption study of the interaction between Rebaudioside A and the T1R2 human sweet taste receptor: modelling and biosensing perspectives
  18. Nanostructured pencil graphite electrodes for application as high power biocathodes in miniaturized biofuel cells and bio-batteries
  19. Classification and functional analyses of putative virulence factors of Mycobacterium tuberculosis: A combined sequence and structure based study
  20. Electrochemical Enzymatic Biosensing of Neotame Supported by Computational Methods
  21. Experimental and Computational Studies of a Laccase Immobilized ZnONPs/GO-Based Electrochemical Enzymatic Biosensor for the Detection of Sucralose in Food Samples
  22. Highly-efficient electrochemical label-free immunosensor for the detection of ochratoxin A in coffee samples
  23. Multivariate optimization of field-flow fractionation of nanoscale synthetic amorphous silica in processed foods supported by computational modelling
  24. Prospective computational design and in vitro bio-analytical tests of new chemical entities as potential selective CYP17A1 lyase inhibitors
  25. Removal of copper (II) from wastewater using green vegetable waste derived activated carbon: An approach to equilibrium and kinetic study
  26. Biogenic synthesis of nanoparticles: A review
  27. Photoelectrochemical Bisphenol S Sensor Based on ZnO‐Nanoroads Modified by Molecularly Imprinted Polypyrrole
  28. The structural basis of acid resistance in Mycobacterium tuberculosis: insights from multiple pH regime molecular dynamics simulations
  29. MWCNTs-Fe2O3nanoparticle nanohybrid-based highly sensitive electrochemicalsensor for the detection of kaempferol in broccoli samples
  30. Computational studies on the molecular insights of aptamer induced poly(N-isopropylacrylamide)-graft-graphene oxide for on/off- switchable whole-cell cancer diagnostics
  31. Theoretical insights into the competitive metal bioaffinity of lactoferrin as a metal ion carrier: a DFT study
  32. High Performance Electrochemical Biosensor for Bisphenol A Using Screen Printed Electrodes Modified with Multiwalled Carbon Nanotubes Functionalized with Silver-Doped Zinc Oxide
  33. Light induced DNA-functionalized TiO2 nanocrystalline interface: Theoretical and experimental insights towards DNA damage detection
  34. Nanotechnology-based water quality management for wastewater treatment
  35. Selectivity and sensitivity enhanced green energy waste based indirect- μ -solid phase extraction of carbaryl supported by DFT and molecular docking studies
  36. Core‐Shell Quantum Dots: Sensing Applications
  37. Smartphone based bioanalytical and diagnosis applications: A review
  38. Green synthesis, characterization and electrochemical sensing of silymarin by ZnO nanoparticles: Experimental and DFT studies
  39. One-pot biosynthesis of silver nanoparticles using Iboza Riparia and Ilex Mitis for cytotoxicity on human embryonic kidney cells
  40. Special Properties of Nanomaterials for Chromatography
  41. Membrane technology for water purification
  42. Capillary Electrophoresis
  43. A Review of Gold and Silver Nanoparticle-Based Colorimetric Sensing Assays
  44. Structural insights into Rab21 GTPase activation mechanism by molecular dynamics simulations
  45. Structural basis of pesticide detection by enzymatic biosensing: a molecular docking and MD simulation study
  46. Multivariate optimization of differential pulse polarographic–catalytic hydrogen wave technique for the determination of nickel(II) in real samples
  47. Robust adsorption of Direct Navy Blue-106 from textile industrial effluents by bio-hydrogen fermented waste derived activated carbon: Equilibrium and kinetic studies
  48. Spectrophotometric determination of nickel (II) in waters and soils: Novel chelating agents and their biological applications supported by DFT method
  49. Molecular dynamics simulation of chitinase I from Thermomyces lanuginosus SSBP to ensure optimal activity
  50. Biosynthesis of ZnO nanoparticles using Jacaranda mimosifolia flowers extract: Synergistic antibacterial activity and molecular simulated facet specific adsorption studies
  51. Dithiocarbamate Induced Catalytic Hydrogen Wave for the determination of Iron (II) in Waters and Leafy Vegetables: Experimental and Computational Approach
  52. Electrochemical sensing platform amplified with a nanobiocomposite of L-phenylalanine ammonia-lyase enzyme for the detection of capsaicin
  53. Hybrid of ZnONPs/MWCNTs for electrochemical detection of aspartame in food and beverage samples
  54. Structure prediction and functional analyses of a thermostable lipase obtained from Shewanella putrefaciens
  55. Effect of pH on the structure, function, and stability of human calcium/calmodulin-dependent protein kinase IV: combined spectroscopic and MD simulation studies
  56. Effect of pH on structure, function, and stability of mitochondrial carbonic anhydrase VA
  57. Urea-induced denaturation of human calcium/calmodulin-dependent protein kinase IV: a combined spectroscopic and MD simulation studies
  58. An ultrasensitive performance enhanced novel cytochrome c biosensor for the detection of rebaudioside A
  59. Insight into the biosensing of graphene oxide: Present and future prospects
  60. Large scale analysis of the mutational landscape in β-glucuronidase: A major player of mucopolysaccharidosis type VII
  61. Monitoring of Cetylpyridinium Chloride Levels in Surface Waters: Patent Blue-V as Selective Ligand for Spectrophotometric Determination
  62. Classification and Functional Analyses of Putative Conserved Proteins from Chlamydophila pneumoniae CWL029
  63. In silico approaches for the identification of virulence candidates amongst hypothetical proteins of Mycoplasma pneumoniae 309
  64. Current Advances in the Identification and Characterization of Putative Drug and Vaccine Targets in the Bacterial Genomes
  65. Designing New Kinase Inhibitor Derivatives as Therapeutics Against Common Complex Diseases: Structural Basis of Microtubule Affinity-Regulating Kinase 4 (MARK4) Inhibition
  66. PKR-inhibitor binds efficiently with human microtubule affinity-regulating kinase 4
  67. Studies on Bacterial Proteins Corona Interaction with Saponin Imprinted ZnO Nanohoneycombs and Their Toxic Responses
  68. Cloning, expression, and molecular dynamics simulations of a xylosidase obtained fromThermomyces lanuginosus
  69. Chitinase from Thermomyces lanuginosus SSBP and its biotechnological applications
  70. Functional Insight into Putative Conserved Proteins of Rickettsia rickettsii and their Virulence Characterization
  71. Towards New Drug Targets? Function Prediction of Putative Proteins of Neisseria meningitidis MC58 and Their Virulence Characterization
  72. Thermostable chitinase II from Thermomyces lanuginosus SSBP: Cloning, structure prediction and molecular dynamics simulations
  73. Fabrication of copper nanoparticles decorated multiwalled carbon nanotubes as a high performance electrochemical sensor for the detection of neotame
  74. Novel Dithiocarbamates for Electrochemical Detection of Nickel(II) in Environmental Samples
  75. Seasonal Variation and Distribution of Anionic Surfactants in and around Tirupati: A Famous Pilgrim Centre in South India
  76. Creation of thermostable and alkaline stable xylanase variants by DNA shuffling
  77. Determination of Neotame by High-Performance Capillary Electrophoresis Using ß-cyclodextrin as a Chiral Selector
  78. Electrochemical Determination of Capsaicin and Silymarin Using a Glassy Carbon Electrode Modified by Gold Nanoparticle Decorated Multiwalled Carbon Nanotubes
  79. Analytical evaluation of steviol glycosides by capillary electrophoresis supported with molecular docking studies
  80. Development of Green Energy Waste Activated Carbon for Removal of Trivalent Chromium: Equilibrium and Kinetic Modeling
  81. Triflic acid promoted fries rearrangement of C-3 vinyl/isopropenyl-azetidin-2-ones: single-pot synthesis of C-3 functionalized-2-aryl-2,3-dihydro-quinoline-4(1H)-ones
  82. Dithiocarbamates as hazardous remediation agent: A critical review on progress in environmental chemistry for inorganic species studies of 20th century
  83. Role of N-terminal residues on folding and stability of C-phycoerythrin: simulation and urea-induced denaturation studies
  84. β-Lactam-Synthon-Interceded Synthesis of Isatin-Imidazolidine-2-thione Conjugates with Structural Validation using Molecular Dynamic Simulations and Cytotoxic Evaluation
  85. Experimental-Like Affinity Constants and Enantioselectivity Estimates from Flexible Docking
  86. Regio- and Diastereoselective Nitroso Diels-Alder Cycloaddition Reactions of 3-dienyl-2-azetidinones with Nitrosoarenes
  87. Erratum to: Connecting simulated, bioanalytical, and molecular docking data on the stereoselective binding of (±)-catechin to human serum albumin
  88. Theoretical study on the formation of a pentacyclo-undecane cage lactam
  89. Synthesis, docking and in vitro antimalarial evaluation of bifunctional hybrids derived from β-lactams and 7-chloroquinoline using click chemistry
  90. Synthetic Studies on the Role of Substituents at C-3 Position on C3-C4 Bond Cleavage of β-Lactam Ring: Convenient Route for Diastereoselective Synthesis of Pyridin-2-ones
  91. Synthesis and evaluation of substituted diphenyl-1,3,4-oxadiazole derivatives for central nervous system depressant activity
  92. Connecting simulated, bioanalytical, and molecular docking data on the stereoselective binding of (±)-catechin to human serum albumin
  93. Preparation, Spectrochemical, and Computational Analysis of L-Carnosine (2-[(3-Aminopropanoyl)amino]-3-(1H-imidazol-5-yl)propanoic Acid) and Its Ruthenium (II) Coordination Complexes in Aqueous Solution
  94. Comparative structural studies of T-20 analogues using molecular dynamics
  95. A computational study of Neuromedin B
  96. Synthesis and docking studies of thiophene scaffolds in COX-2
  97. Computational Study of the Free Energy Landscape of the Miniprotein CLN025 in Explicit and Implicit Solvent
  98. Conformational profile of bombesin assessed using different computational protocols
  99. Molecular dynamics simulations of Ac-3Aib-Cage-3Aib-NHMe
  100. Conformational space search of Neuromedin C using replica exchange molecular dynamics and molecular dynamics
  101. Toward a Quality Guide to Facilitate the Transference of Analytical Methods from Research to Testing Laboratories: A Case Study
  102. Cycloaddition reactions of cross-conjugated enaminones
  103. Molecular dynamics (MD) simulations of VIP and PACAP27
  104. Conformational Study of the PCU Cage Monopeptide: A Key Role of Some Force-Field Parameters
  105. Determination of lead and cadmium in seawater by differential pulse anodic stripping voltammetry: fit-for-purpose partial validation and internal quality aspects
  106. Trishomocubane Amino Acid as a β-turn scaffold
  107. A molecular dynamics study of the pentacyclo-undecane (PCU) cage polypeptides of the type Ac-3Ala-Cage-3Ala-NHMe
  108. A molecular dynamics study of the pentacyclo-undecane cage amino acid tripeptide
  109. Analysis of the conformational profile of trishomocubane amino acid dipeptide
  110. Simulated annealing study of the pentacyclo-undecane cage amino acid tripeptides of the type [Ac-X-Y-Z-NHMe]
  111. A theoretical study of pentacyclo-undecane cage peptides of the type [Ac-X-Y-NHMe]
  112. Conformational analysis of small peptides of the type Ac–X–NHMe, where X=Gly, Ala, Aib and Cage
  113. Computational study of the conformational preferences of the(R)-8-amino-pentacyclo[,6.03,10.05,9] undecane-8-carboxylic acid monopeptide
  114. CHAPTER 1. Perspective on Analytical Sciences and Nanotechnology